4-(3-methylbutoxy)-5,6,7,8-tetrahydroisoquinoline-3-carboxylic acid

Systemtic Name: 4-(3-methylbutoxy)-5,6,7,8-tetrahydroisoquinoline-3-carboxylic acid Openeye Name: 4-isopentyloxy-5,6,7,8-tetrahydroisoquinoline-3-carboxylic acid CAS Name: 4-(3-methylbutoxy)-5,6,7,8-tetrahydroisoquinoline-3-carboxylic acid IUPAC Name: 4-(3-methylbutoxy)-5,6,7,8-tetrahydroisoquinoline-3-carboxylic acid Traditional Name: 4-isoamoxy-5,6,7,8-tetrahydroisoquinoline-3-carboxylic acid Formula: C15H21NO3 MolecularWeight: 263.33214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=C2CCCCC2=CN=C1C(=O)O

Isomeric SMILES

CC(C)CCOC1=C2CCCCC2=CN=C1C(=O)O

InChI

InChI=1S/C15H21NO3/c1-10(2)7-8-19-14-12-6-4-3-5-11(12)9-16-13(14)15(17)18/h9-10H,3-8H2,1-2H3,(H,17,18)